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CHEBI:209909 - 3alpha,16alpha,26-trihydroxylanosta-7,9(11),24-trien-21-oic acid

Default Structure
ChEBI IDCHEBI:209909
ChEBI Name3alpha,16alpha,26-trihydroxylanosta-7,9(11),24-trien-21-oic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H46O5
Net Charge0
Average Mass486.693
Monoisotopic Mass486.33452
SMILESC/C(=C\CC[C@@H](C(=O)O)[C@H]1[C@H](O)C[C@@]2(C)C3=CC[C@H]4C(C)(C)[C@H](O)CC[C@]4(C)C3=CC[C@]12C)CO
InChIInChI=1S/C30H46O5/c1-18(17-31)8-7-9-19(26(34)35)25-22(32)16-30(6)21-10-11-23-27(2,3)24(33)13-14-28(23,4)20(21)12-15-29(25,30)5/h8,10,12,19,22-25,31-33H,7,9,11,13-17H2,1-6H3,(H,34,35)/b18-8+/t19-,22-,23+,24-,25+,28-,29-,30+/m1/s1
InChIKeyPJJIWWUPWPLBRE-XOSWQPBISA-N
Species of MetaboliteComponentSourceComments
Ganoderma applanatum (ncbitaxon:29884) - PubMed (16933889)
ChEBI Ontology
Outgoing Relation(s)
3alpha,16alpha,26-trihydroxylanosta-7,9(11),24-trien-21-oic acid (CHEBI:209909) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(E,2R)-2-[(3R,5R,10S,13R,14R,16R,17R)-3,16-dihydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-7-hydroxy-6-methylhept-5-enoic acid
Manual XrefsDatabases
17241869ChemSpider